COMPUTED DESCRIPTORS
| Molecular Weight | 418.4 g/mol |
|---|---|
| XLogP3 | -1.2 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 11 |
| Rotatable Bond Count | 9 |
| Exact Mass | 418.14751164 g/mol |
| Monoisotopic Mass | 418.14751164 g/mol |
| Topological Polar Surface Area | 161 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 633 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 8 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Secoxyloganin methyl ester is a natural product found in Sinoadina racemosa, Lippia graveolens, and other organisms with data available.